hexoxy-dimethyl-pentan-2-yloxysilane

C13H30O2Si — CID 91733309

IUPAChexoxy-dimethyl-pentan-2-yloxysilane
SMILESCCCCCCO[Si](C)(C)OC(C)CCC
InChIInChI=1S/C13H30O2Si/c1-6-8-9-10-12-14-16(4,5)15-13(3)11-7-2/h13H,6-12H2,1-5H3
InChIKeySPMGUXBENXZXII-UHFFFAOYSA-N
MW246.47 g/mol
LogP4.49
Rot. Bonds10

About hexoxy-dimethyl-pentan-2-yloxysilane

hexoxy-dimethyl-pentan-2-yloxysilane (PubChem CID 91733309) has the molecular formula C13H30O2Si and a molecular weight of 246.47 g/mol. Its IUPAC name is hexoxy-dimethyl-pentan-2-yloxysilane.

Molecular Properties

Compound Namehexoxy-dimethyl-pentan-2-yloxysilane
PubChem CID91733309
Molecular FormulaC13H30O2Si
Molecular Weight246.47 g/mol
Exact Mass246.20
IUPAC Namehexoxy-dimethyl-pentan-2-yloxysilane
SMILESCCCCCCO[Si](C)(C)OC(C)CCC
InChIInChI=1S/C13H30O2Si/c1-6-8-9-10-12-14-16(4,5)15-13(3)11-7-2/h13H,6-12H2,1-5H3
InChIKeySPMGUXBENXZXII-UHFFFAOYSA-N
XLogP4.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.47
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hexoxy-dimethyl-pentan-2-yloxysilane?
The IUPAC name of hexoxy-dimethyl-pentan-2-yloxysilane (CID 91733309) is hexoxy-dimethyl-pentan-2-yloxysilane.
What is the SMILES notation for hexoxy-dimethyl-pentan-2-yloxysilane?
The canonical SMILES for hexoxy-dimethyl-pentan-2-yloxysilane is CCCCCCO[Si](C)(C)OC(C)CCC.
What is the InChIKey of hexoxy-dimethyl-pentan-2-yloxysilane?
The InChIKey is SPMGUXBENXZXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O2Si/c1-6-8-9-10-12-14-16(4,5)15-13(3)11-7-2/h13H,6-12H2,1-5H3.
What are the key properties of hexoxy-dimethyl-pentan-2-yloxysilane?
hexoxy-dimethyl-pentan-2-yloxysilane has a molecular weight of 246.47 g/mol, XLogP of 4.49, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexoxy-dimethyl-pentan-2-yloxysilane is sourced from PubChem (CID 91733309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).